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ISSN Online: 2377-424X

ISBN Print: 978-1-56700-421-2

International Heat Transfer Conference 15
August, 10-15, 2014, Kyoto, Japan

A Simulation Study Into the Thermodynamic Properties of Water-Alcohol Mixtures

Get access (open in a dialog) DOI: 10.1615/IHTC15.tdy.009370
pages 7755-7761

要約

The sensitivity of thermodynamic properties of alcohol-water mixtures to the atomic make-up of the alcohol has resulted in significant interest in understanding such mixtures from a molecular perspective. Advances in both computational power and models meanwhile offer the means for deeper investigation into such properties using molecular simulation, and in this manuscript we describe studies into the thermodynamic properties of an alcohol-water mixture using Molecular Dynamics simulation, along with experimental validation.